Microsolvation of Sarcosine: A DFT Study
碩士 === 國立中正大學 === 化學暨生物化學研究所 === 102 === Structures and energies of sarcosine-one-water to sarcosine-four-water clusters were computed by DFT method to examine the effects of microsolvation on the relative stability of the zwitterion and neutral forms of sarcosine. wB97XD/6-311++G(d,p)//wB97XD/ 6-31...
| Main Authors: | , |
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| Other Authors: | |
| Format: | Others |
| Language: | en_US |
| Published: |
2014
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| Online Access: | http://ndltd.ncl.edu.tw/handle/10595703809044068018 |